2-hydroxy-5-(thiocyanatomethyl)benzoic acid
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2-hydroxy-5-(thiocyanatomethyl)benzoic acid
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CAS No:
5435-62-1
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Formula:
C9H7NO3S
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Chemical Name:
2-hydroxy-5-(thiocyanatomethyl)benzoic acid
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Synonyms:
5435-62-1;Benzoic acid, 2-hydroxy-5-(thiocyanatomethyl)-;2-hydroxy-5-(thiocyanatomethyl)benzoic acid;NSC21479;2, .alpha.-thiocyanato-;DTXSID00969441;ZINC1577723;NSC-21479;DS-007123;2-Hydroxy-5-[(thiocyanato)methyl]benzoic acid
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CAS No:
Computed Properties
Molecular Weight:209.22
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:209.01466426
Monoisotopic Mass:209.01466426
Topological Polar Surface Area:107
Heavy Atom Count:14
Complexity:260
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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